{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.7062343 -4.6993903 -4.2271623 ] [ -0.0949475 -0.5425627 0.2485106 ] [ -0.3538187 3.3018203 -4.6878998 ] [ -6.5772334 -2.3062297 12.6226037 ] [ 21.3975507 2.1354106 3.5486227 ] [ 5.3346832 2.1109518 -7.5046749 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.157286787946705e-08 -7.529253270674299e-09 -6.772660609387156e-09 ] [ -1.52122664703408e-10 -8.692812732581241e-10 3.981578733409805e-10 ] [ -5.668800491418489e-10 5.290099290742842e-09 -7.510843460212996e-09 ] [ -1.053788958302489e-08 -3.694987307534597e-09 2.022364054176358e-08 ] [ 3.428265547392267e-08 3.421304939128501e-09 5.685520325980173e-09 ] [ 8.547104702414531e-09 3.382117621595677e-09 -1.202381467148458e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.835457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.896249250188371e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1168862 0.5412192 -0.166276 ] [ 0.2690171 0.3466323 2.033242 ] [ 0.5696875 2.6065905 1.0772729 ] [ 1.401323 1.9891266 3.2526883 ] [ 2.7028274 0.6537725 1.7268324 ] [ 2.6743457 2.2812446 -0.0496374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1168862e-10 5.412192000000001e-11 -1.66276e-11 ] [ 2.690171e-11 3.466323e-11 2.033242e-10 ] [ 5.696875e-11 2.6065905e-10 1.0772729e-10 ] [ 1.401323e-10 1.9891266e-10 3.2526883e-10 ] [ 2.7028274e-10 6.537725e-11 1.7268324e-10 ] [ 2.6743457e-10 2.2812446e-10 -4.96374e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.26e-05 -4.26e-05 5.63e-05 ] [ 1.8e-06 1e-07 -5.59e-05 ] [ 7.67e-05 3.51e-05 1.72e-05 ] [ -2e-06 -1.58e-05 2.2e-06 ] [ -4.06e-05 5.85e-05 -4.98e-05 ] [ -7.85e-05 -3.52e-05 3.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.825272404608e-14 -6.825272404608e-14 9.020254375104e-14 ] [ 2.88391791744e-15 1.6021766208e-16 -8.956167310272e-14 ] [ 1.2288694681536e-13 5.623639939008e-14 2.755743787776e-14 ] [ -3.2043532416e-15 -2.531439060864e-14 3.52478856576e-15 ] [ -6.504837080448e-14 9.37273323168e-14 -7.978839571583999e-14 ] [ -1.257708647328e-13 -5.639661705216e-14 4.822551628608e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.320379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.216989588439529e-18 } }